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Chalcones

dorsmanin A

琉桑素A

PHY-NP-06649 · Natural product research catalog

Catalog numberPHY-NP-06649
CAS number162229-27-8
Molecular formulaC20H20O4
Molecular weight324.376 g/mol
Chemical classChalcones
Main reported sourceDorstenia mannii
Purity / assayMin. 98%
Other purity specifications available on inquiry.

Chemical structure

Chemical structure of dorsmanin A

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Product information

dorsmanin A is listed in the Chalcones section of the Phytide Bio research catalog. Standard pack sizes are 5, 10, 20, 50 and 100 mg.

For research use only. Not for human or veterinary use, diagnosis or treatment.

Names & identifiers

IUPAC name(E)-1-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)-3-(4-hydroxyphenyl)prop-2-en-1-one
SMILESCC1(CCC2=C(O1)C=CC(=C2O)C(=O)/C=C/C3=CC=C(C=C3)O)C
InChIKeyUDSAJERKQRQHJR-WEVVVXLNSA-N
Subclass / scaffoldChalcones
PubChem CID5472480

Computed properties

Exact mass (Da)324.1362Predicted LogP4.0975
Predicted TPSA (Ų)66.76H-bond donors2
H-bond acceptors4Rotatable bonds3

Calculated values from the supplied dataset; not measured batch specifications.

View additional properties & classification
Ring count3
Aromatic rings2
Fraction Csp³0.25
Synthetic accessibility score2.57
QED score0.659
Lipinski rule violations0
NPClassifier pathwayShikimates and Phenylpropanoids
NPClassifier superclassFlavonoids
NPClassifier classChalcones
Parent SMILESCC1(C)CCc2c(ccc(C(=O)/C=C/c3ccc(O)cc3)c2O)O1
Parent formulaC20H20O4
Parent molecular weight324.376
Specified stereocenters0
Unspecified stereocenters0

Reported natural occurrence

Main reported sourceDorstenia mannii
Reported source familiesMoraceae; Apiaceae

Reported natural occurrence does not establish the manufacturing origin of the supplied material.

View occurrence records & references
LOTUS / Wikidata speciesDorstenia mannii[2]; Ashitaba[1]; Dorstenia prorepens[1]; Dorstenia zenkeri[1]
All reported source familiesMoraceae[3]; Apiaceae[1]
LOTUS species records4
LOTUS reference records4
COCONUT occurrence recordsAngelica keiskei; Ashitaba; Dorstenia mannii; Dorstenia prorepens; Dorstenia zenkeri
COCONUT organism records5
COCONUT identifierCNP0173605.1

Records are inherited from the supplied dataset and are not independently verified. Taxonomic names may include synonyms.

Documents & specifications

Certificate of analysis (COA)Batch-specific COA available on request; no PDF published yet
Safety data sheet (SDS)Not yet published
Storage / solubilityProduct-specific conditions to be confirmed
ShippingConfirmed with the quotation

Request applicable documentation and handling information before ordering or use.